methyl 3-[(5Z,9Z,15Z,19Z)-18-(3-methoxy-3-oxidanylidene-propyl)-3,7,12,17-tetramethyl-2H-porphyrin-22,23,24-triid-2-yl]propanoate; oxidanylidenevanadium

Systemtic Name: methyl 3-[(5Z,9Z,15Z,19Z)-18-(3-methoxy-3-oxidanylidene-propyl)-3,7,12,17-tetramethyl-2H-porphyrin-22,23,24-triid-2-yl]propanoate; oxidanylidenevanadium Openeye Name: methyl 3-[(5Z,9Z,15Z,19Z)-18-(3-methoxy-3-oxo-propyl)-3,7,12,17-tetramethyl-2H-porphyrin-22,23,24-triid-2-yl]propanoate; oxovanadium CAS Name: 3-[(5Z,9Z,15Z,19Z)-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-2H-porphyrin-22,23,24-triid-2-yl]propanoic acid methyl ester; oxovanadium IUPAC Name: methyl 3-[(5Z,9Z,15Z,19Z)-18-(3-methoxy-3-oxopropyl)-3,7,12,17-tetramethyl-2H-porphyrin-22,23,24-triid-2-yl]propanoate; oxovanadium Traditional Name: 3-[(5Z,9Z,15Z,19Z)-18-(3-keto-3-methoxy-propyl)-3,7,12,17-tetramethyl-2H-porphine-22,23,24-triid-2-yl]propionic acid methyl ester; ketovanadium Formula: C32H33N4O5V-3 MolecularWeight: 604.56972

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Descriptors Computed from Structure

Canonical SMILES:

CC1=CC2=CC3=C(C=C([N-]3)C=C4C(=C(C(=CC5=NC(=C(C5CCC(=O)OC)C)C=C1[N-]2)[N-]4)CCC(=O)OC)C)C.O=[V]

Isomeric SMILES

CC\1=C/C/2=C/C3=C(C=C([N-]3)/C=C\4/C(=C(/C(=C/C5=NC(=C(C5CCC(=O)OC)C)/C=C1\[N-]2)/[N-]4)CCC(=O)OC)C)C.O=[V]

InChI

InChI=1S/C32H33N4O4.O.V/c1-17-11-22-14-27-19(3)23(7-9-31(37)39-5)29(35-27)16-30-24(8-10-32(38)40-6)20(4)28(36-30)15-26-18(2)12-21(34-26)13-25(17)33-22;;/h11-16,24H,7-10H2,1-6H3;;/q-3;;/b26-15-;;